二氢硫辛酸
TL;DR: 二氢硫辛酸 (CAS 462-20-4) is a chemical compound with molecular formula C8H16O2S2 and molecular weight 208.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二氢硫辛酸
6,8-bis(sulfanyl)octanoic acid
Also Known As: Dihydrolipoic acid, dihydrolipoate, Dihydrothioctic acid, Dihydrolipoicacid, 6,8-Dimercaptooctanoic acid
| Molecular Formula | C8H16O2S2 |
|---|---|
| Molecular Weight | 208.06 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 39.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 208.05917 |
| Heavy Atoms | 12 |
| Complexity | 128.0 |
Chemical Identifiers
| CAS Number | 462-20-4 |
|---|---|
| SMILES | C(CCC(=O)O)CC(CCS)S |
| InChIKey | IZFHEQBZOYJLPK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二氢硫辛酸 (CAS 462-20-4), with molecular formula C8H16O2S2 and molecular weight 208.06 g/mol. IUPAC: 6,8-bis(sulfanyl)octanoic acid.
Chemical Property Profile of 二氢硫辛酸
Property Insights of 二氢硫辛酸
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 二氢硫辛酸. With a topological polar surface area (TPSA) of 39.3 Ų, 二氢硫辛酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二氢硫辛酸 has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 二氢硫辛酸?
The CAS number of 二氢硫辛酸 is 462-20-4.
What is the molecular formula of 二氢硫辛酸?
The molecular formula of 二氢硫辛酸 is C8H16O2S2.
What is the molecular weight of 二氢硫辛酸?
The molecular weight of 二氢硫辛酸 is 208.06 g/mol.
Where can I buy 二氢硫辛酸?
You can request a quote for 二氢硫辛酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二氢硫辛酸?
Yes, KEHONG BIO provides custom synthesis services for 二氢硫辛酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.